Symmetry-adapted polynomial basis for global potential energy surfaces-applications to \(XY_{4}\) molecules

DOI10.1007/s10910-008-9354-yzbMath1243.81237OpenAlexW1990245097MaRDI QIDQ843272

Frédéric Patras, Patrick Cassam-Chenaï

Publication date: 12 October 2009

Published in: Journal of Mathematical Chemistry (Search for Journal in Brave)

Full work available at URL: https://doi.org/10.1007/s10910-008-9354-y

Mathematics Subject Classification ID

Molecular physics (81V55)

Related Items

Algorithms for fundamental invariants and equivariants of finite groups, Partition of symmetric powers of \(G\)-sets into orbits: application to the enumeration of force constants, A fast algorithm for the construction of integrity bases associated to symmetry-adapted polynomial representations: application to tetrahedral XY\(_{\mathrm{4}}\) molecules, Building symmetric polynomials to fit a potential energy surface: application to an \({\mathrm A_2\mathrm B_2}\) molecule, Studies on the effects of nonadiabatic behavior during the course of HBr photolysis, Molien generating functions and integrity bases for the action of the \(\mathrm{SO}(3)\) and \(\mathrm{O}(3)\) groups on a set of vectors

Cites Work

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